[(1S)-1-[(2S)-4-ethyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[(2S)-4-ethyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium Openeye Name: [(1S)-1-[(2S)-4-ethyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium CAS Name: [(1S)-1-[(2S)-4-ethyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium IUPAC Name: [(1S)-1-[(2S)-4-ethyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]azanium Traditional Name: [(1S)-1-[(2S)-4-ethyl-3-keto-2-methyl-1,4-benzoxazin-6-yl]ethyl]ammonium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(C)[NH3+])OC(C1=O)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[C@H](C)[NH3+])O[C@H](C1=O)C

InChI

InChI=1S/C13H18N2O2/c1-4-15-11-7-10(8(2)14)5-6-12(11)17-9(3)13(15)16/h5-9H,4,14H2,1-3H3/p+1/t8-,9-/m0/s1